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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c6-yneFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1930.78657929; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c1Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1817.80421985; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations H2O2Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-151.615070481; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c2Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1817.31242439; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations alkyneFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-308.494717503; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations TS-c4-OAc-c5Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1700.55818722; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations TS-c8-c9Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1779.12982508; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c4-OAcFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1700.58620775; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations 5Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-2904.39024100; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations OAcFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-228.697666228; Eh
Results 21-30 of 333 (Search time: 0.001 seconds).